Caroline Mellot-Draznieks

发表

Coenzyme Q Biosynthesis: Evidence for a Substrate Access Channel in the FAD-Dependent Monooxygenase Coq6

Fabien Pierrel, Alexandre Ismail, Vincent Leroux, 2016, PLoS Comput. Biol..

Computational exploration of metal–organic frameworks: examples of advances in crystal structure predictions and electronic structure tuning

Caroline Mellot-Draznieks, C. Mellot‐Draznieks, 2015 .

Computational design and prediction of interesting not-yet-synthesized structures of inorganic materials by using building unit concepts.

Gérard Férey, J. C. Schön, J Christian Schön, 2002, Chemistry.

A Bioinspired Nickel(bis-dithiolene) Complex as a Homogeneous Catalyst for Carbon Dioxide Electroreduction

Caroline Mellot-Draznieks, Marc Fontecave, M. Fontecave, 2018 .

Engineering the optical response of the titanium-MIL-125 metal-organic framework through ligand functionalization.

Aron Walsh, Christopher H. Hendon, Capucine Sassoye, 2013, Journal of the American Chemical Society.

Role of computer simulations in structure prediction and structure determination: from molecular compounds to hybrid frameworks

Caroline Mellot-Draznieks, C. Mellot‐Draznieks, 2007 .

A hybrid solid with giant pores prepared by a combination of targeted chemistry, simulation, and powder diffraction.

Gérard Férey, Caroline Mellot-Draznieks, Christian Serre, 2004, Angewandte Chemie.

Hybrid organic-inorganic frameworks: routes for computational design and structure prediction.

Gérard Férey, Caroline Mellot-Draznieks, C. Mellot‐Draznieks, 2004, Angewandte Chemie.

Exceptionally low shear modulus in a prototypical imidazole-based metal-organic framework.

Bartolomeo Civalleri, Caroline Mellot-Draznieks, Raimondas Galvelis, 2012, Physical review letters.

Novel inorganic frameworks constructed from double-four-ring (D4R) units: computational design, structures, and lattice energies of silicate, aluminophosphate, and gallophosphate candidates.

Gérard Férey, Caroline Mellot-Draznieks, C. Mellot‐Draznieks, 2002, Journal of the American Chemical Society.

Tackling the Defect Conundrum in UiO-66: A Mixed-Linker Approach to Engineering Missing Linker Defects

Caroline Mellot-Draznieks, Francis Taulelle, Thomas D. Bennett, 2017 .

Computational Design and Prediction of Interesting Not‐Yet‐Synthesized Structures of Inorganic Materials by Using Building Unit Concepts

Gérard Férey, Martin Jansen, Caroline Mellot-Draznieks, 2002 .

Hydrogen storage in the giant-pore metal-organic frameworks MIL-100 and MIL-101.

Gérard Férey, Caroline Mellot-Draznieks, Jin-Ho Lee, 2006, Angewandte Chemie.